SCHEMBL4377512

SCHEMBL4377512

CCC(C)(C)N1CCN(C(=O)CCC(=O)c2ccc(F)cc2)CC1

nearest known ligand 0.76

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 10/20 0.76
HTT P42858 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
POLB P06746 2/20 0.56
MAPT P10636 1/20 0.56
KMT2A Q03164 2/20 0.55
KDM4E B2RXH2 1/20 0.54
DRD2 P14416 1/20 0.50
DRD4 P21917 1/20 0.50
DRD3 P35462 1/20 0.50
MEN1 O00255 1/20 0.46
PSMD14 O00487 1/20 0.46
MMP2 P08253 1/20 0.46

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL4381928 0.99 HRH3 (0.78) HRH3HTTSMN1; SMN2POLBMAPT
SCHEMBL4377725 0.87 HRH3 (0.97) HRH3HTTSMN1; SMN2POLBDRD2
Hydrochloric Acid SCHEMBL4378983 0.86 HRH3 (1.00) HRH3POLBDRD2DRD4DRD3
SCHEMBL4377712 0.80 HRH3 (0.63) HRH3HTTSMN1; SMN2POLBDRD2
SCHEMBL4377916 0.80 HRH3 (0.67) HRH3HTTSMN1; SMN2POLB
Hydrochloric Acid SCHEMBL4375661 0.79 HRH3 (0.68) HRH3HTTSMN1; SMN2POLB
SCHEMBL4386127 0.78 HRH3 (1.00) HRH3HTTSMN1; SMN2POLBMAPT
SCHEMBL11792815 0.78 HTT (0.73) HRH3HTTSMN1; SMN2POLBMAPT
SCHEMBL19231620 0.77 FKBP1A (0.60) HRH3HTTSMN1; SMN2POLBMAPT
Hydrochloric Acid SCHEMBL4381864 0.77 HRH3 (1.00) HRH3HTTSMN1; SMN2POLBMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1421071-B1 SUBSTITUTED PIPERAZINE AND DIAZEPANE DERIVAIVES AS HISTAMINE H3 RECEPTOR MODULATORS HIGH POINT PHARMACEUTICALS LLC (US) 2009-11-18 EP claimed
EP-1421071-B1 SUBSTITUTED PIPERAZINE AND DIAZEPANE DERIVAIVES AS HISTAMINE H3 RECEPTOR MODULATORS HIGH POINT PHARMACEUTICALS LLC (US) 2009-11-18 EP disclosed
US-20080113968-A1 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2008-05-15 US disclosed
US-20080113968-A1 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2008-05-15 US disclosed
US-7208497-B2 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2007-04-24 US disclosed
US-7208497-B2 Substituted piperazines and diazepanes NOVO NORDISK A/S (DK) 2007-04-24 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080113968-A1 Substituted piperazines and diazepanes HRH3, HRH4, HRH1 HRH3 1/4885HTT 360/4885SMN1; SMN2 2684/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.